BAS 02251236
TL;DR: BAS 02251236 (CAS 372974-69-1) is a chemical compound with molecular formula C14H12INO3S3 and molecular weight 464.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(1,1-dioxothiolan-3-yl)-5-[(4-iodophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 02251236, (Z)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-5-(4-iodobenzylidene)-2-thioxothiazolidin-4-one, (5Z)-3-(1,1-dioxothiolan-3-yl)-5-[(4-iodophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C14H12INO3S3 |
|---|---|
| Molecular Weight | 464.90 g/mol |
| LogP | 2.6795 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 464.9024 |
| Heavy Atoms | 22 |
| Complexity | 771.0277 |
Chemical Identifiers
| CAS Number | 372974-69-1 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1N2C(=O)/C(=C/C3=CC=C(C=C3)I)/SC2=S |
Product Overview
BAS 02251236 (CAS 372974-69-1), with molecular formula C14H12INO3S3 and molecular weight 464.90 g/mol. IUPAC: (5Z)-3-(1,1-dioxothiolan-3-yl)-5-[(4-iodophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 02251236
Property Insights of BAS 02251236
The XLogP value of 2.6795 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02251236. With a topological polar surface area (TPSA) of 54.45 Ų, BAS 02251236 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02251236 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02251236?
The CAS number of BAS 02251236 is 372974-69-1.
What is the molecular formula of BAS 02251236?
The molecular formula of BAS 02251236 is C14H12INO3S3.
What is the molecular weight of BAS 02251236?
The molecular weight of BAS 02251236 is 464.90 g/mol.
Where can I buy BAS 02251236?
You can request a quote for BAS 02251236 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02251236?
Yes, KEHONG BIO provides custom synthesis services for BAS 02251236 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.